N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C23H27N3O3S2/c1-18-10-13-26(14-11-18)31(28,29)22-8-6-19(7-9-22)23(27)25-12-15-30-17-21-5-3-2-4-20(21)16-24/h2-9,18H,10-15,17H2,1H3,(H,25,27)